Vitas-M small molecule compound

azepan-1-yl{1-[(4-chloro-3,5-dimethylphenoxy)methyl]-1H-pyrazol-3-yl}methanone

Catalog ID
STK308674
SMILES O=C(c1ccn(n1)COc1cc(C)c(c(c1)C)Cl)N1CCCCCC1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C19H24ClN3O2 MW 361.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H24ClN3O2/c1-14-11-16(12-15(2)18(14)20)25-13-23-10-7-17(21-23)19(24)22-8-5-3-4-6-9-22/h7,10-12H,3-6,8-9,13H2,1-2H3
InChIKey
WEJXPIWFBCBTLW-UHFFFAOYSA-N
Synonyms
1005574-32-2
1005574322
azepan1yl(1((4chloro35dimethylphenoxy)methyl)1Hpyrazol3yl)methanone
AZEPAN1YL(1((4CHLORO35DIMETHYLPHENOXY)METHYL)PYRAZOL3YL)METHANONE
CC1=CC(=CC(=C1Cl)C)OCN2C=CC(=N2)C(=O)N3CCCCCC3
InChI=1SC19H24ClN3O2c1141116(1215(2)18(14)20)25132310717(2123)19(24)2285346922h71012H368913H212H3
MFCD04051283
ZINC000002797886
ZINC02797886
ZINC2797886

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.